UCSF

ZINC08698125

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2007 12 No

Popular Name: 2-Methoxy-5-nitro-3-picoline 2-Methoxy-5-nitro-3-picoline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 6635-90-1 , 89694-10-0 , [89694-10-0]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.60 0.39 -4.95 0 5 0 67 168.152 2 ↓
Lo Low (pH 4.5-6) 1.60 0.95 -35.69 1 5 1 69 169.16 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.